SCHEMBL5635879

SCHEMBL5635879

Cc1ccccc1C(=O)/C=C/N1CCN2CCC1C2

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 1/20 0.39
POLB P06746 3/20 0.38
ALDH1A1 P00352 2/20 0.38
KMT2A Q03164 1/20 0.37
CHRNA7 P36544 1/20 0.37
HTT P42858 1/20 0.37
ALOX15 P16050 1/20 0.37
MAPT P10636 1/20 0.37
PBRM1 Q86U86 2/20 0.36
NR1I2 O75469 1/20 0.36
ADRA1A P35348 1/20 0.36
ADRA1B P35368 1/20 0.36
OPRK1 P41145 1/20 0.36
HTR2B P41595 1/20 0.36
SMARCA2 P51531 1/20 0.36
SMARCA4 P51532 1/20 0.36
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4029015 0.92 CHRNA7 (0.41) GPR52POLBALDH1A1KMT2ACHRNA7
SCHEMBL4026644 0.77 ABCG2 (0.49) GPR52ALDH1A1HTTMAPTLMNA
SCHEMBL372771 0.73 CHRNA7 (0.43) POLBALDH1A1KMT2ACHRNA7MAPT
SCHEMBL5635882 0.70 GPR183 (0.42) POLBKMT2ACHRNA7MAPTHPGD
SCHEMBL14381384 0.70 GPR183 (0.42) POLBKMT2ACHRNA7MAPTHPGD
SCHEMBL11528932 0.69 GPR52 (0.61) GPR52ALDH1A1HTTMAPTLMNA
SCHEMBL11528927 0.69 GPR52 (0.61) GPR52ALDH1A1HTTMAPTLMNA
SCHEMBL14808705 0.69 ALDH1A1 (0.58) ALDH1A1HTT
SCHEMBL4033241 0.67 CHRNA7 (0.58) GPR52POLBALDH1A1KMT2ACHRNA7
SCHEMBL4032717 0.67 GAA (0.48) GPR52ALDH1A1KMT2AALOX15MAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070244097-A1 Nicotinic AcetylcholineReceptor Ligands ASTRAZENECA AB (SE) 2007-10-18 US claimed
US-20070244097-A1 Nicotinic AcetylcholineReceptor Ligands ASTRAZENECA AB (SE) 2007-10-18 US disclosed
EP-1699802-A1 NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS AstraZeneca AB (SE) 2006-09-13 EP disclosed
WO-2005061511-A1 NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS ASTRAZENECA AB (SE) 2005-07-07 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070244097-A1 Nicotinic AcetylcholineReceptor Ligands CHRNG, CHRNE, CHRNA1 GPR52 141/4885POLB 4283/4885ALDH1A1 951/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.